[(2S,3R,4S,6S)-4-azido-2-methyl-6-(4-methylphenyl)sulfanyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3R,4S,6S)-4-azido-2-methyl-6-(4-methylphenyl)sulfanyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3R,4S,6S)-4-azido-2-methyl-6-(p-tolylsulfanyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,4S,6S)-4-azido-2-methyl-6-[(4-methylphenyl)thio]-3-oxanyl] ester IUPAC Name: [(2S,3R,4S,6S)-4-azido-2-methyl-6-(4-methylphenyl)sulfanyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,4S,6S)-4-azido-2-methyl-6-(p-tolylthio)tetrahydropyran-3-yl] ester Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)SC2=CC=C(C=C2)C)N=[N+]=[N-])OC(=O)C

Isomeric SMILES

C[C@H]1[C@@H]([C@H](C[C@@H](O1)SC2=CC=C(C=C2)C)N=[N+]=[N-])OC(=O)C

InChI

InChI=1S/C15H19N3O3S/c1-9-4-6-12(7-5-9)22-14-8-13(17-18-16)15(10(2)20-14)21-11(3)19/h4-7,10,13-15H,8H2,1-3H3/t10-,13-,14-,15-/m0/s1